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(5Z)-5-[(3-chloro-5-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-[(3-chloro-5-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C21H17ClF3NO4S2

SMILES: COC1=CC(C=C2/SC(=S)N(C)C2=O)=CC(Cl)=C1OCCOC1=CC=CC(=C1)C(F)(F)F

IUPAC: (5Z)-5-[(3-chloro-5-methoxy-4-{2-[3-(trifluoromethyl)phenoxy]ethoxy}phenyl)methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C21H17ClF3NO4S2/c1-26-19(27)17(32-20(26)31)10-12-8-15(22)18(16(9-12)28-2)30-7-6-29-14-5-3-4-13(11-14)21(23,24)25/h3-5,8-11H,6-7H2,1-2H3/b17-10-

Composition: C (50.05%), H (3.40%), Cl (7.03%), F (11.31%), N (2.78%), O (12.70%), S (12.72%)

Molar Mass: 503.94

Atom Count: 49

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 503.0239626
Formal Charge 0
FSP3 0.24
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey HPZPOVQXVBYZTO-YVLHZVERSA-N
Lipinski's Rule of Five
Molar Refractivity 123.37
Topological Polar Surface Area 48
Polarizability 46.47
Ring Count 3
Rotatable Bond Count 8

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H17ClF3NO4S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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